N-[3-(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)propanoyl]isoleucine
Chemical Structure Depiction of
N-[3-(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)propanoyl]isoleucine
N-[3-(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)propanoyl]isoleucine
Compound characteristics
| Compound ID: | Y041-1731 |
| Compound Name: | N-[3-(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)propanoyl]isoleucine |
| Molecular Weight: | 413.47 |
| Molecular Formula: | C23 H27 N O6 |
| Smiles: | CC[C@H](C)[C@H](C(O)=O)NC(CCC1=C(C)c2cc3c(C)c(C)oc3cc2OC1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.622 |
| logD: | -0.9651 |
| logSw: | -2.7879 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.339 |
| InChI Key: | RTMWZVZZSDUVRP-FIKIJFGZSA-N |